SCHEMBL6570586

SCHEMBL6570586

O=C(NS(=O)(=O)[N+]1(C2CCNCC2)CCC(Oc2ccc(Cl)c(Cl)c2)CC1)C1=C[N]C(=O)c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 16/20 0.39
HRH1 P35367 15/20 0.39
KCNH2 Q12809 5/20 0.39
UTS2R Q9UKP6 1/20 0.35
P2RX7 Q99572 1/20 0.35
CHRM1 P11229 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6568905 0.80 HRH1 (0.46) CCR3HRH1KCNH2UTS2RP2RX7
SCHEMBL6569252 0.78 HRH1 (0.54) CCR3HRH1KCNH2
SCHEMBL6570664 0.72 SLC6A2 (0.48) CCR3HRH1KCNH2UTS2RP2RX7
SCHEMBL6568478 0.69 HRH1 (0.48) CCR3HRH1KCNH2UTS2R
SCHEMBL6569446 0.68 CCR3 (0.56) CCR3HRH1KCNH2UTS2R
SCHEMBL6647507 0.68 CCR3 (0.47) CCR3HRH1KCNH2
SCHEMBL6567411 0.67 HRH1 (0.46) CCR3HRH1KCNH2P2RX7
SCHEMBL6569229 0.67 HRH1 (0.47) CCR3HRH1KCNH2UTS2RP2RX7
SCHEMBL7016612 0.65 HRH1 (0.41) CCR3HRH1KCNH2UTS2RP2RX7
SCHEMBL6568359 0.65 CCR8 (0.41) CCR3HRH1CHRM1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1404667-A1 PIPERIDINE DERIVATIVES USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY AstraZeneca AB (SE) 2004-04-07 EP disclosed
WO-2003004487-A1 PIPERIDINE DERIVATIVES USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA AB (SE) 2003-01-16 WO disclosed